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Geometry for S3 (Sulfur trimer) 1A1 C2V

1910171554
InChI=1S/S3/c1-3-2 INChIKey=NVSDADJBGGUCLP-UHFFFAOYSA-N

PBEPBE/6-31G(2df,p)


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.6618   0.0000 0.6618 0.0000
S2 0.0000 1.6701 -0.3309   1.6701 -0.3309 0.0000
S3 0.0000 -1.6701 -0.3309   -1.6701 -0.3309 0.0000
Atom - Atom Distances (Å)
  S1 S2 S3
S1 1.9428 1.9428
S2 1.9428 3.3402
S3 1.9428 3.3402
Maximum atom distance is 3.3402Å between atoms S2 and S3.
picture of Sulfur trimer
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S2 S1 S3 118.549

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.